54T
Summary
| Name: | 6-chloro-1,3-benzothiazol-2-amine |
| Formula: | C7 H5 Cl N2 S |
| Formal charge: | 0 |
| Formula weight: | 184.646 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-chloro-1,3-benzothiazol-2-amine |
| OpenEye OEToolkits | 1.9.2 | 6-chloranyl-1,3-benzothiazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2c1c(cc(cc1)Cl)sc2N |
| InChI | InChI | 1.03 | InChI=1S/C7H5ClN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10) |
| InChIKey | InChI | 1.03 | VMNXKIDUTPOHPO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1sc2cc(Cl)ccc2n1 |
| SMILES | CACTVS | 3.385 | Nc1sc2cc(Cl)ccc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc2c(cc1Cl)sc(n2)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cc2c(cc1Cl)sc(n2)N |
